Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-Octene
RN: 111-66-0
UNII: E5VK21B9RC
InChIKey: KWKAKUADMBZCLK-UHFFFAOYSA-N

Molecular Formula

  • C8-H16

Molecular Weight

  • 112.214
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 1-Octene
  • Caprylene

Synonyms

  • 1-Caprylene
  • 1-Octylene
  • AI3-28403
  • alpha-Octene
  • Caprylene
  • EC 203-893-7
  • EINECS 203-893-7
  • HSDB 1084
  • n-1-Octene
  • NSC 8457
  • OCTENE-1
  • Octylene
  • UNII-E5VK21B9RC

Systematic Names

  • 1-Octene
  • Oct-1-ene

Superlist Name

  • 1-Octene

Registry Numbers

CAS Registry Number

  • 111-66-0

FDA UNII

  • E5VK21B9RC

System Generated Number

  • 0000111660

Structure Descriptors

InChI

1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3

InChIKey

KWKAKUADMBZCLK-UHFFFAOYSA-N

Smiles

C(CCC=C)CCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.02E+02 deg C   EXP
Boiling Point 121.2 deg C   EXP
log P (octanol-water) 4.57 (none)   EXP
Water Solubility 4.1 mg/L 25 EXP
Vapor Pressure 17.4 mm Hg 25 EXP
Henry's Law Constant 0.627 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.30E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.